Molecule ID: mol6773

SMILES: Nc1nc(Cl)cnc1C=O

InChI: InChI=1S/C5H4ClN3O/c6-4-1-8-3(2-10)5(7)9-4/h1-2H,(H2,7,9)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
-1.64 OCHEM 1 » 0
-1.64 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization